HRID1553051

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID81531

Diisopropylethylamine

C8H19N

HCID94429

Triphosgene

C3Cl6O3

HCID171473

3-Isoxazolamine, 5-(1,1-dimethylethyl)-

C7H12N2O

HCID57484122

未命名化合物

PRODUCTS

生成物

结构：CC(C)Cn1ncc2cc(Oc3ccc(F)cc3CNC(=O)Nc3cc(C(C)(C)C)on3)ccc21

HCID42642211

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-66013d5dd382465dbea55c921be53083
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

[C:45]([CH3:46])([CH3:47])([CH3:48])[c:49]1[cH:50][c:51]([NH2:54])[n:52][o:53]1.[CH:24]([N:25]([CH2:26][CH3:27])[CH:28]([CH3:29])[CH3:30])([CH3:31])[CH3:32].[Cl:33][C:34]([Cl:35])([O:36][C:37]([O:38][C:39]([Cl:40])([Cl:41])[Cl:42])=[O:43])[Cl:44].[Cl:55][CH2:56][Cl:57].[F:1][c:2]1[cH:3][cH:4][c:5]([O:10][c:11]2[cH:12][c:13]3[cH:14][n:15][n:16]([CH2:20][CH:21]([CH3:22])[CH3:23])[c:17]3[cH:18][cH:19]2)[c:6]([CH2:7][NH2:8])[cH:9]1>>[F:1][c:2]1[cH:3][cH:4][c:5]([O:10][c:11]2[cH:12][c:13]3[cH:14][n:15][n:16]([CH2:20][CH:21]([CH3:22])[CH3:23])[c:17]3[cH:18][cH:19]2)[c:6]([CH2:7][NH:8][C:37](=[O:43])[NH:54][c:51]2[cH:50][c:49]([C:45]([CH3:46])([CH3:47])[CH3:48])[o:53][n:52]2)[cH:9]1